AC1LJP5N
(5E)-1-(3-chloro-2-methylphenyl)-5-[(2,5-dimethyl-1-pyridin-3-ylpyrrol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: AH-487/41656680|(5E)-1-(3-chloro-2-methylphenyl)-5-[(2,5-dimethyl-1-pyridin-3-ylpyrrol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione|(5E)-1-(3-chloro-2-methylphenyl)-5-{[2,5-dimethyl-1-(pyridin-3-yl)-1H-pyrrol-3-yl]methylidene}-2-thioxodihydropyrimidine-4,6(1H,5H)-dione|1-(3-chloro-2-methylphenyl)-5-{[2,5-dimethyl-1-(3-pyridinyl)-1H-pyrrol-3-yl]methylene}-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
| Molecular Formula | C23H19ClN4O2S |
|---|---|
| Molecular Weight | 450.09174 g/mol |
| LogP | 4.28226 |
| Topological Polar Surface Area | 67.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 450.09174 |
| Monoisotopic Mass | 450.09174 |
| Heavy Atoms | 31 |
| Complexity | 1264.0809 |
Chemical Identifiers
| CAS Number | 664357-57-7 |
|---|---|
| SMILES | CC1=CC(=C(N1C2=CN=CC=C2)C)/C=C/3\C(=O)NC(=S)N(C3=O)C4=C(C(=CC=C4)Cl)C |
Product Overview
AC1LJP5N (CAS 664357-57-7), with molecular formula C23H19ClN4O2S and molecular weight 450.09174 g/mol. IUPAC: (5E)-1-(3-chloro-2-methylphenyl)-5-[(2,5-dimethyl-1-pyridin-3-ylpyrrol-3-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione.